| SpectraBase Spectrum ID |
D77kvR5eevb |
| Name |
2-(6-Acetoxy-3-oxo-3H-xanthen-9-yl)benzoic acid, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.094688229 u |
| Formula |
C23H16O6 |
| InChI |
InChI=1S/C23H16O6/c1-13(24)28-15-8-10-19-21(12-15)29-20-11-14(25)7-9-18(20)22(19)16-5-3-4-6-17(16)23(26)27-2/h3-12H,1-2H3 |
| InChIKey |
ZKDQOSUIENKNBM-UHFFFAOYSA-N |
| Molecular Weight |
388.375 g/mol |
| SMILES |
C=12C=CC(C=C2OC=2C(C1C1=C(C=CC=C1)C(=O)OC)=CC=C(C2)OC(=O)C)=O |
